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CHEBI:30818 - cis-urocanic acid

ChEBI IDCHEBI:30818
ChEBI Namecis-urocanic acid
Stars
ASCII Namecis-urocanic acid
DefinitionA urocanic acid in which the double bond of the carboxyethene moiety has Z configuration.
Last Modified9 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H6N2O2
Net Charge0
Average Mass138.126
Monoisotopic Mass138.04293
SMILESO=C(O)/C=C\c1cncn1
InChIInChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1-
InChIKeyLOIYMIARKYCTBW-UPHRSURJSA-N
Roles Classification
Chemical Roles:
chromophore  The part (atom or group of atoms) of a molecular entity in which the electronic transition responsible for a given spectral band is approximately localized.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
cis-urocanic acid (CHEBI:30818) is a urocanic acid (CHEBI:27248)
cis-urocanic acid (CHEBI:30818) is conjugate acid of cis-urocanate (CHEBI:30819)
Incoming Relation(s)
cis-urocanate (CHEBI:30819) is conjugate base of cis-urocanic acid (CHEBI:30818)
IUPAC Name 
(2Z)-3-(1H-imidazol-4-yl)prop-2-enoic acid
Synonyms  Source
(Z)-imidazole-4-acrylic acidChemIDplus
cis-urocanic acidChemIDplus
Registry NumbersSources
Beilstein:81404Beilstein
CAS:7699-35-6ChemIDplus